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Home > Encyclopedia > 3-[(1-BENZYL-1H-BENZIMIDAZOL-2-YL)THIO]PROPANOIC ACID

3-[(1-BENZYL-1H-BENZIMIDAZOL-2-YL)THIO]PROPANOIC ACID

3-[(1-BENZYL-1H-BENZIMIDAZOL-2-YL)THIO]PROPANOIC ACID structure

3-[(1-BENZYL-1H-BENZIMIDAZOL-2-YL)THIO]PROPANOIC ACID 

structure
  • CAS No:

    303132-83-4

  • Formula:

    C17H16N2O2S

  • Chemical Name:

    3-[(1-BENZYL-1H-BENZIMIDAZOL-2-YL)THIO]PROPANOIC ACID

  • Synonyms:

    3-[(1-Benzyl-1H-benzimidazol-2-yl)thio]-propanoic acid;3-(1-Benzyl-1H-benzoimidazol-2-ylsulfanyl)-propionic acid;3-[(1-benzyl-1H-benzimidazol-2-yl)sulfanyl]propanoic acid;CBMicro_009653;3-[1-benzylbenzimidazol-2-ylthio]propanoic acid;Oprea1_699047;Oprea1_843906;MLS001209548;CHEMBL1373013;SCHEMBL17068754

3-[(1-BENZYL-1H-BENZIMIDAZOL-2-YL)THIO]PROPANOIC ACID Basic Attributes

312.39

312.093

2933990090

Characteristics

80.4

3.4

43.7 [ug/mL]

Safety Information

IRRITANT

Xi

Computed Properties

Molecular Weight:312.4
XLogP3:3.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:312.09324893
Monoisotopic Mass:312.09324893
Topological Polar Surface Area:80.4
Heavy Atom Count:22
Complexity:374
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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